ethyl-dimethyl-[2-methyl-1-oxidanyl-1,16-bis(oxidanylidene)-16-tetradecoxy-hexadecan-2-yl]azanium

Systemtic Name: ethyl-dimethyl-[2-methyl-1-oxidanyl-1,16-bis(oxidanylidene)-16-tetradecoxy-hexadecan-2-yl]azanium Openeye Name: (1-carboxy-1-methyl-15-oxo-15-tetradecoxy-pentadecyl)-ethyl-dimethyl-ammonium CAS Name: ethyl-(1-hydroxy-2-methyl-1,16-dioxo-16-tetradecoxyhexadecan-2-yl)-dimethylammonium IUPAC Name: ethyl-(1-hydroxy-2-methyl-1,16-dioxo-16-tetradecoxyhexadecan-2-yl)-dimethylazanium Traditional Name: (1-carboxy-15-keto-1-methyl-15-myristyloxy-pentadecyl)-ethyl-dimethyl-ammonium Formula: C35H70NO4+ MolecularWeight: 568.9346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCC(C)(C(=O)O)[N+](C)(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCC(C)(C(=O)O)[N+](C)(C)CC

InChI

InChI=1S/C35H69NO4/c1-6-8-9-10-11-12-13-17-20-23-26-29-32-40-33(37)30-27-24-21-18-15-14-16-19-22-25-28-31-35(3,34(38)39)36(4,5)7-2/h6-32H2,1-5H3/p+1